2-[[8-[(3S)-3-azanylpyrrolidin-1-yl]-1-cyclopropyl-7-fluoranyl-9-methyl-4-oxidanylidene-quinolizin-3-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[8-[(3S)-3-azanylpyrrolidin-1-yl]-1-cyclopropyl-7-fluoranyl-9-methyl-4-oxidanylidene-quinolizin-3-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[8-[(3S)-3-aminopyrrolidin-1-yl]-1-cyclopropyl-7-fluoro-9-methyl-4-oxo-quinolizine-3-carbonyl]amino]acetic acid CAS Name: 2-[[[8-[(3S)-3-amino-1-pyrrolidinyl]-1-cyclopropyl-7-fluoro-9-methyl-4-oxo-3-quinolizinyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[8-[(3S)-3-aminopyrrolidin-1-yl]-1-cyclopropyl-7-fluoro-9-methyl-4-oxoquinolizine-3-carbonyl]amino]acetic acid Traditional Name: 2-[[8-[(3S)-3-aminopyrrolidino]-1-cyclopropyl-7-fluoro-4-keto-9-methyl-quinolizine-3-carbonyl]amino]acetic acid Formula: C20H23FN4O4 MolecularWeight: 402.419423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN2C1=C(C=C(C2=O)C(=O)NCC(=O)O)C3CC3)F)N4CCC(C4)N

Isomeric SMILES

CC1=C(C(=CN2C1=C(C=C(C2=O)C(=O)NCC(=O)O)C3CC3)F)N4CC[C@@H](C4)N

InChI

InChI=1S/C20H23FN4O4/c1-10-17-13(11-2-3-11)6-14(19(28)23-7-16(26)27)20(29)25(17)9-15(21)18(10)24-5-4-12(22)8-24/h6,9,11-12H,2-5,7-8,22H2,1H3,(H,23,28)(H,26,27)/t12-/m0/s1